{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.4737 0 0 ] "si-unit" "m" "si-value" [ 5.4737e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00330015 5.48579 0 ] "si-unit" "m" "si-value" [ -3.30015e-13 5.48579e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0734366 -0.160082 5.49307 ] "si-unit" "m" "si-value" [ 7.34366e-12 -1.60082e-11 5.49307e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.150853 0.00970189 0.0764733 ] [ 1.36952 1.32009 1.51972 ] [ 0.0340703 2.70337 2.97189 ] [ 1.37909 3.89909 4.39384 ] [ 2.73154 -0.0872152 2.86586 ] [ 4.10719 1.23544 4.14892 ] [ 2.70311 2.76853 0.030971 ] [ 4.04883 4.00647 1.36661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.50853e-11 9.70189e-13 7.647329999999999e-12 ] [ 1.36952e-10 1.32009e-10 1.51972e-10 ] [ 3.40703e-12 2.70337e-10 2.97189e-10 ] [ 1.37909e-10 3.89909e-10 4.39384e-10 ] [ 2.73154e-10 -8.72152e-12 2.86586e-10 ] [ 4.10719e-10 1.23544e-10 4.148920000000001e-10 ] [ 2.70311e-10 2.76853e-10 3.0971e-12 ] [ 4.04883e-10 4.00647e-10 1.36661e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0870965 0.1901495 0.7920357 ] [ -0.4956736 0.3358129 -0.5876596 ] [ -0.8044637 -0.8182537 -1.8823277 ] [ -0.409303 2.6526004 -2.1139002 ] [ -0.5166401 -1.213228 -0.4776884 ] [ 0.2767659 0.3090154 0.8619307 ] [ 0.0499915 -2.5142583 1.4963988 ] [ 0.8122263 1.0581618 1.9112107 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.741720596853507e-09 3.046530833568096e-10 1.268981081378963e-09 ] [ -7.941566534677709e-10 5.380315773430484e-10 -9.415344721086796e-10 ] [ -1.288892932422265e-09 -1.310986948023097e-09 -3.015821433624236e-09 ] [ -6.557756974233024e-10 4.249934345204728e-09 -3.386841479144444e-09 ] [ -8.277486895877741e-10 -1.943805537299942e-09 -7.653411865073588e-10 ] [ 4.434278544146707e-10 4.950972493471603e-10 1.380965216289779e-09 ] [ 8.00952125387232e-11 -4.028285866912353e-09 2.397495172753175e-09 ] [ 1.301329988658887e-09 1.695362096983645e-09 3.062097100962803e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.124689 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.787813214947093e-18 } }